SCHEMBL670186

SCHEMBL670186

CC(=O)Oc1cc2c3c(ccc2c2c1=CC=C2)=CC=CC3

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
TSHR P16473 1/20 0.31
RAB9A P51151 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15526804 0.73
SCHEMBL668900 0.68
SCHEMBL29564692 0.66
SCHEMBL15903863 0.63
SCHEMBL670187 0.63 ALDH1A1 (0.40) KDM4EALDH1A1GAATSHRRAB9A
SCHEMBL15903546 0.63
SCHEMBL15540285 0.63 HTT (0.47) KDM4EALDH1A1GAATSHR
SCHEMBL15903796 0.63
SCHEMBL16226028 0.62
SCHEMBL8081069 0.62 TNFSF11 (0.56) KDM4EALDH1A1GAATSHRRAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012022880-A2 METHOD FOR SYNTHESIZING STEROIDS UNIVERSITE DE STRASBOURG (FR) 2012-02-23 WO disclosed